2-[(2S)-4-[(3-ethyl-1,2-oxazol-5-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(3-ethyl-1,2-oxazol-5-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(3-ethylisoxazol-5-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(3-ethyl-5-isoxazolyl)methyl]-1-methyl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(3-ethyl-1,2-oxazol-5-yl)methyl]-1-methylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(3-ethylisoxazol-5-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Formula: C13H24N3O2+ MolecularWeight: 254.34856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1)CN2CC[NH+](C(C2)CCO)C

Isomeric SMILES

CCC1=NOC(=C1)CN2CC[NH+]([C@H](C2)CCO)C

InChI

InChI=1S/C13H23N3O2/c1-3-11-8-13(18-14-11)10-16-6-5-15(2)12(9-16)4-7-17/h8,12,17H,3-7,9-10H2,1-2H3/p+1/t12-/m0/s1